From d7a748e2d7d8174f870276df8c08c1c0d49213a9 Mon Sep 17 00:00:00 2001 From: Terumasa TADANO Date: Sat, 2 Oct 2021 02:02:08 +0900 Subject: [PATCH 1/2] Change version number and added Bug report section --- README.md | 4 ++-- docs/source/conf.py | 4 ++-- docs/source/download.rst | 5 +---- docs/source/install.rst | 4 ++-- docs/source/intro.rst | 13 +++++++++++-- include/version.h | 2 +- 6 files changed, 19 insertions(+), 13 deletions(-) diff --git a/README.md b/README.md index 45cb68ef..449c9f47 100644 --- a/README.md +++ b/README.md @@ -3,7 +3,7 @@ [![License][license-image]][license-url] [![Doc status][docs-image]][docs-url] -### Version 1.2.0 +### Version 1.3.0 ![alt ALAMODE](./docs/img/alamode.png) @@ -89,7 +89,7 @@ http://alamode.readthedocs.io ## License -Copyright (c) 2014--2019 Terumasa Tadano +Copyright (c) 2014--2021 Terumasa Tadano This software is released under the MIT license. For license rights and limitations, see LICENSE.txt file. diff --git a/docs/source/conf.py b/docs/source/conf.py index ccba45eb..2f53af67 100644 --- a/docs/source/conf.py +++ b/docs/source/conf.py @@ -57,9 +57,9 @@ # built documents. # # The short X.Y version. -version = '1.2' +version = '1.3' # The full version, including alpha/beta/rc tags. -release = '1.2.0' +release = '1.3.0' # The language for content autogenerated by Sphinx. Refer to documentation # for a list of supported languages. diff --git a/docs/source/download.rst b/docs/source/download.rst index 3a0ec91b..524f922c 100644 --- a/docs/source/download.rst +++ b/docs/source/download.rst @@ -1,12 +1,9 @@ Download ======== -.. highlight:: bash - - You can download the latest and previous versions of ALAMODE at http://sourceforge.net/projects/alamode . -You can also download the package from the git repository as +You can also download the package from the git repository as:: $ git clone http://github.com/ttadano/alamode.git diff --git a/docs/source/install.rst b/docs/source/install.rst index 71459036..be9cd21d 100644 --- a/docs/source/install.rst +++ b/docs/source/install.rst @@ -46,7 +46,7 @@ VMD may be more useful to make an animation, but it may be replaced by any other Install using conda (recommended for non-experts) ------------------------------------------------- -.. highlight:: bash +..highlight:: bash This option is recommended for all users who want to build working binaries. If you want to build highly-optimized binaries using the Intel compiler and other optimized libraries, @@ -59,7 +59,7 @@ Step 1. Preparing build tools by conda At first, it is recommended `to prepare a conda environment `_ by:: - % conda create --name alamode -c conda-forge python=3.7 + % conda create --name alamode -c conda-forge python=3 % conda activate alamode Here the name of the conda environment is chosen ``alamode``. The detailed diff --git a/docs/source/intro.rst b/docs/source/intro.rst index bca015ce..0620d970 100644 --- a/docs/source/intro.rst +++ b/docs/source/intro.rst @@ -69,7 +69,7 @@ License .. |copy| unicode:: U+000A9 -Copyright |copy| 2014, 2015, 2016 Terumasa Tadano +Copyright |copy| 2014–2021 Terumasa Tadano This software is distributed under the MIT license. See the LICENSE.txt file for license rights and limitations. @@ -94,10 +94,19 @@ please cite the following paper as well: Y\. Oba, T. Tadano, R. Akashi, and S. Tsuneyuki, Phys. Rev. Materials **3**\, 033601 (2019). [`Link `__] + +Issues & Bug report +------------------- + +* If you find a bug or issue related to ALAMODE, please report it at `GitHub issues `_. +* Other questions and suggestions can be posted on the `GitHub discussion page. `_ + +In either case, please search the previous questions and read FAQ page of this document before asking. + Acknowledgment -------------- -This project is/was partially supported by the following projects: +This project was partially supported by the following projects: * Grant-in-Aid for Young Scientists (B) (16K17724) * Grant-in-Aid for Scientific Research on Innovative Areas 'Materials Design through Computics: Complex Correlation and Non-Equilibrium Dynamics'. (http://computics-material.jp) diff --git a/include/version.h b/include/version.h index 3bda1193..51097b0d 100644 --- a/include/version.h +++ b/include/version.h @@ -12,4 +12,4 @@ #include -static const std::string ALAMODE_VERSION = "1.2.0"; +static const std::string ALAMODE_VERSION = "1.3.0"; From bb7213e26f7c69b246e4e92704b2264ea3386f5a Mon Sep 17 00:00:00 2001 From: Terumasa TADANO Date: Sat, 2 Oct 2021 02:21:40 +0900 Subject: [PATCH 2/2] Update changelog --- ChangeLog.md | 13 +++++++++++++ LICENSE.txt | 2 +- README.md | 2 +- 3 files changed, 15 insertions(+), 2 deletions(-) diff --git a/ChangeLog.md b/ChangeLog.md index e799a99b..c529ce18 100644 --- a/ChangeLog.md +++ b/ChangeLog.md @@ -1,3 +1,16 @@ +# Ver. 1.3.0 (2021-10-01) + +## Changes + +- For OpenMX, displace.py now generates atomic positions in Cartesian coordinate instead of the fractional coordinate. +- Refactor the codes for future major release (This release does not change the user interface.) + +## Fixes + +- Fix a few bugs in the SCP class. The stability of the phonon frequency interpolation has been improved. +- Fix other minor bugs and typos in documentation and header parts of output files. + + # Ver. 1.2.0 (2021-04-02) ## New features diff --git a/LICENSE.txt b/LICENSE.txt index e5779bc7..38f9f0b9 100644 --- a/LICENSE.txt +++ b/LICENSE.txt @@ -1,6 +1,6 @@ The MIT License (MIT) -Copyright (c) 2014,2015,2016 Terumasa Tadano +Copyright (c) 2014 Terumasa Tadano Permission is hereby granted, free of charge, to any person obtaining a copy of this software and associated documentation files (the "Software"), to deal diff --git a/README.md b/README.md index 449c9f47..4ad87ac4 100644 --- a/README.md +++ b/README.md @@ -89,7 +89,7 @@ http://alamode.readthedocs.io ## License -Copyright (c) 2014--2021 Terumasa Tadano +Copyright (c) 2014–2021 Terumasa Tadano This software is released under the MIT license. For license rights and limitations, see LICENSE.txt file.